tert-butyl 4-[(2R)-2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2R)-2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2R)-2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[(2R)-2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2R)-2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[(2R)-2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(C2=C3C=C(C=CC3=NC=C2)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C[C@@H](C2=C3C=C(C=CC3=NC=C2)OC)O

InChI

InChI=1S/C21H29N3O4/c1-21(2,3)28-20(26)24-11-9-23(10-12-24)14-19(25)16-7-8-22-18-6-5-15(27-4)13-17(16)18/h5-8,13,19,25H,9-12,14H2,1-4H3/t19-/m0/s1